Vitas-M small molecule compound

2-[5-(3-chlorophenyl)-1,3-dioxo-5,6,11,11a-tetrahydro-1H-imidazo[1',5':1,6]pyrido[3,4-b]indol-2(3H)-yl]benzoic acid

Catalog ID
STL457216
SMILES Clc1cccc(c1)C1N2C(Cc3c1[nH]c1c3cccc1)C(=O)N(C2=O)c1ccccc1C(=O)O

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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.

We do not supply quantities above 5 g.

Structure and other identifiers

2D representation rendered from the SMILES, with core physicochemical data.
Formula C26H18ClN3O4 MW 471.90 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H18ClN3O4/c27-15-7-5-6-14(12-15)23-22-18(16-8-1-3-10-19(16)28-22)13-21-24(31)30(26(34)29(21)23)20-11-4-2-9-17(20)25(32)33/h1-12,21,23,28H,13H2,(H,32,33)
InChIKey
SHMQLCFNRHPQHR-UHFFFAOYSA-N
Synonyms

2((11aS)5(3chlorophenyl)13dioxo1111adihydro1Himidazo(1516)pyrido(34b)indol2(3H5H6H)yl)benzoicacid
2(10(3chlorophenyl)13diketo3a4910tetrahydroimidazo(15b)$bcarbolin2yl)benzoicacid
2(5(3chlorophenyl)13dioxo561111atetrahydro1Himidazo(1516)pyrido(34b)indol2(3H)yl)benzoicacid
C1C2C(=O)N(C(=O)N2C(C3=C1C4=CC=CC=C4N3)C5=CC(=CC=C5)Cl)C6=CC=CC=C6C(=O)O
Clc1cccc(c1)C1N2(C@@H)(Cc3c1(nH)c1c3cccc1)C(=O)N(C2=O)c1ccccc1C(=O)O
Clc1cccc(c1)C1N2C(Cc3c1(nH)c1c3cccc1)C(=O)N(C2=O)c1ccccc1C(=O)O
InChI=1SC26H18ClN3O4c271575614(1215)232218(168131019(16)2822)132124(31)30(26(34)29(21)23)201142917(20)25(32)33h112212328H13H2(H3233)
MFCD10007655
ZINC000003882111
ZINC000011767283

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Available files

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